Basic information
- Standard SMILES
Nc1cccc(-c2nn3ccccc3c2-c2ccnc(Nc3ccc(Cl)c(OCCN4CCCC4)c3)n2)c1- InChIKey
LXXNXRFPUVGHPH-UHFFFAOYSA-N- Molecular formula
- C29H28ClN7O
- Average molar mass
- 526 g/mol
Names & identifiers
- Preferred name
- 4-[2-(3-Aminophenyl)pyrazolo[1,5-a]pyridin-3-yl]-N-(4-chloro-3-{[2-(1-pyrrolidinyl)ethyl]oxy}phenyl)-2-pyrimidinamine
- IUPAC
- 4-[2-(3-aminophenyl)pyrazolo[1,5-a]pyridin-3-yl]-N-[4-chloro-3-(2-pyrrolidin-1-ylethoxy)phenyl]pyrimidin-2-amine
Names & synonyms
SCHEMBL3537746LXXNXRFPUVGHPH-UHFFFAOYSA-N4-[2-(3-Aminophenyl)pyrazolo[1,5-a]pyridin-3-yl]-N-(4-chloro-3-{[2-(1-pyrrolidinyl)ethyl]oxy}phenyl)-2-pyrimidinamine
Database identifiers
- PubChem CID
- 57737228
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 93.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 8
- Heavy atoms
- 38
- Formal charge
- 0
- Complexity
- 742
Related reactions
3 records
Compound notes
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